SCHEMBL1727693

SCHEMBL1727693

N#Cc1cc(O)c2ccn(-c3ccc(O)c(F)c3)c2c1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.40
ESRRA P11474 2/20 0.36
FFAR4 Q5NUL3 1/20 0.35
CDC7 O00311 1/20 0.34
CDK2 P24941 1/20 0.34
P4HB P07237 1/20 0.34
CAPN1 P07384 1/20 0.34
ESR1 P03372 6/20 0.34
ESR2 Q92731 6/20 0.34
CYP19A1 P11511 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1017182 0.81 ESRRA (0.39) ESRRACAPN1ESR1ESR2
SCHEMBL1013393 0.79 S1PR5 (0.37) FFAR4CYP19A1
SCHEMBL2002221 0.76 PGR (0.40) ARP4HBESR1ESR2CYP19A1
SCHEMBL12532079 0.76 ESR1 (0.36) ESRRACAPN1ESR1ESR2
SCHEMBL1728583 0.76 TRPA1 (0.37) ESRRACAPN1ESR1ESR2
SCHEMBL1727305 0.76 HSD17B1 (0.43) ESRRAFFAR4CAPN1ESR1ESR2
SCHEMBL1014234 0.73 ESRRA (0.39) ESRRACAPN1ESR1ESR2
SCHEMBL4439652 0.69 PGR (0.34) AR
SCHEMBL1876893 0.68 LMNA (0.43)
SCHEMBL12151412 0.68 ESRRA (0.34) ESRRACAPN1ESR1ESR2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012009617-A3 METHODS, STORAGE MEDIUMS, AND SYSTEMS FOR ANALYZING PARTICLE QUANTITY AND DISTRIBUTION WITHIN AN IMAGING REGION OF AN ASSAY ANALYSIS SYSTEM AND FOR EVALUATING THE PERFORMANCE OF A FOCUSING ROUTING PERFORMED ON AN ASSAY ANALYSIS SYSTEM LUMINEX CORPORATION (US) 2012-05-10 WO claimed
EP-2271617-B1 SUBSTITUTED 4-HYDROXY-N- (4-HYDROXYPHENYL) INDOLES AS ESTROGENIC AGENTS GLAXO GROUP LTD (GB) 2011-11-30 EP claimed
US-7956083-B2 Compounds GLAXO GROUP LIMITED (GB) 2011-06-07 US claimed
US-20100324106-A1 COMPOUNDS GLAXO GROUP LIMITED (GB) 2010-12-23 US claimed
WO-2012009617-A3 METHODS, STORAGE MEDIUMS, AND SYSTEMS FOR ANALYZING PARTICLE QUANTITY AND DISTRIBUTION WITHIN AN IMAGING REGION OF AN ASSAY ANALYSIS SYSTEM AND FOR EVALUATING THE PERFORMANCE OF A FOCUSING ROUTING PERFORMED ON AN ASSAY ANALYSIS SYSTEM LUMINEX CORPORATION (US) 2012-05-10 WO disclosed
EP-2271617-B1 SUBSTITUTED 4-HYDROXY-N- (4-HYDROXYPHENYL) INDOLES AS ESTROGENIC AGENTS GLAXO GROUP LTD (GB) 2011-11-30 EP disclosed
US-7956083-B2 Compounds GLAXO GROUP LIMITED (GB) 2011-06-07 US disclosed
US-7956083-B2 Compounds GLAXO GROUP LIMITED (GB) 2011-06-07 US disclosed
US-20100324106-A1 COMPOUNDS GLAXO GROUP LIMITED (GB) 2010-12-23 US disclosed
US-20100324106-A1 COMPOUNDS GLAXO GROUP LIMITED (GB) 2010-12-23 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100324106-A1 COMPOUNDS ESR2, GPER1, ESR1 AR 27/4885ESRRA 6/4885FFAR4 244/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.